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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Accurate calculation of anharmonic vibrational frequencies of medium sized molecules using local coupled cluster

Tomica Hrenar1, Hans-Joachim Werner, Guntram Rauhut

  • 1Institut für Theoretische Chemie, Universität Stuttgart, Pfaffenwaldring 55, 70569 Stuttgart, Germany.

The Journal of Chemical Physics
|April 14, 2007
PubMed

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